* LIGAND DATABASE FILE (OPLS2005)
*
001     110   113    205    323     607
    1     0 S   NP   _N1_     1    28.49195    94.12499   -21.75246
    2     1 S   H    _HN1     2     1.02777    93.14383   -76.80709
    3     1 S   H    _H1_     3     1.02954    90.04717    31.51470
    4     1 S   H    _H2_     4     1.02822    28.24963   159.94169
    5     1 S   CT   _CA1     5     1.50162   138.88382   153.60743
    6     5 S   HC   _HA1     6     1.09573   105.21010    62.69811
    7     5 S   CO3  _C1_     7     1.53798   112.11879   -57.46481
    8     7 S   O2Z  _O11     8     1.26414   114.98192   -47.65197
    9     7 S   O2Z  _O12     9     1.26223   114.92159   131.08713
   10     5 S   CT   _CB1    10     1.53024   107.31720  -179.46955
   11    10 S   HC   HB11    11     1.09828   109.33575   -49.51317
   12    10 S   HC   HB12    12     1.09820   110.47280    67.02979
   13    10 S   CT   _CG1    13     1.53002   112.69934  -170.54867
   14    13 S   HC   HG11    14     1.09492   110.49882   -61.89088
   15    13 S   HC   HG12    15     1.09646   110.05907    57.22050
   16    13 S   C    _CD1    16     1.51817   111.95928   177.11323
   17    16 S   O    _OE1    17     1.22785   123.09238    -8.83440
   18    16 S   N    _N2_    18     1.38655   111.94401   172.26399
   19    18 S   H    _HN2    19     1.01575   119.13324     0.28324
   20    18 S   CT1  _CA2    20     1.46264   123.11082   178.96846
   21    20 S   HC   _HA2    21     1.09756   109.16380    -4.14468
   22    20 S   C    _C2_    22     1.53452   108.66085  -119.46586
   23    22 S   O    _O2_    23     1.23030   122.42381  -149.26537
   24    20 S   CT   _CB2    32     1.53588   112.02347   117.50972
   25    24 S   HC   HB21    33     1.09476   109.76337    60.41701
   26    24 S   HC   HB22    34     1.09244   109.06281   179.45464
   27    22 S   N    _N3_    24     1.38390   113.59092    38.33897
   28    27 S   H    _HN3    25     1.01619   119.49144    -3.78274
   29    24 S   S    _SG2    35     1.82635   110.92122   -60.74537
   30    27 S   CT   _CA3    26     1.45271   123.07951   176.88586
   31    30 S   HC   HA31    27     1.09554   107.55607   -63.13856
   32    30 S   HC   HA32    28     1.09561   107.90686    53.24988
   33    29 S   CT   _C25    36     1.88544   102.37409   178.36051
   34    30 S   CO3  _C3_    29     1.52915   114.18253   175.23634
   35    34 S   O2Z  _O31    30     1.26359   116.09165     0.02798
   36    34 S   O2Z  _O32    31     1.26436   114.39777  -179.93744
   37    33 S   CM   _C15    37     1.54777   106.32885    78.16260
   38    33 S   CT   _C24    92     1.57969   112.61944  -159.23078
   39    33 S   OH   _O36   109     1.43387   108.13848   -42.99586
   40    39 S   HO   _H22   110     0.97226   106.58592   -43.81417
   41    37 S   CMA  _C14    38     1.37196   125.91693   -98.07644
   42    41 S   OM   _O40    39     1.26789   127.40743    -2.86942
   43    38 S   OH   _O37    93     1.44613   107.81737   161.37324
   44    43 S   HO   _H23    94     0.97423   106.94062   -45.22382
   45    41 S   CA   _C12    40     1.53835   114.35987   174.42916
   46    45 S   CA   _C11    41     1.42162   120.23525   -26.06481
   47    46 S   CA   _C10    42     1.41970   121.59426  -173.76549
   48    46 S   CT   _C17    75     1.51519   117.83652     9.13052
   49    48 S   HC   _H18    76     1.09566   110.96039   153.14962
   50    48 S   HC   _H19    77     1.09662   109.72813   -87.38910
   51    47 S   CA   _C9_    43     1.40764   118.44989    -3.21144
   52    51 S   HA   _H16    44     1.08374   118.05656   179.52812
   53    47 S   NE   _N8_    66     1.40315   120.86926   176.37739
   54    37 S   CT   _C16    78     1.52736   114.50149    80.59196
   55    54 S   HC   _H3_    79     1.10272   106.29992   112.83868
   56    51 S   CA   _C8_    45     1.39404   121.56759     0.54249
   57    53 S   CT   _C29    67     1.45903   115.14821   -75.92336
   58    57 S   HC   _H32    68     1.09543   110.26915   168.47551
   59    57 S   HC   _H33    69     1.09447   112.41787    49.06503
   60    57 S   HC   _H34    70     1.09587   110.55328   -72.13710
   61    53 S   CT   _C30    71     1.45673   118.54758   138.61451
   62    61 S   HC   _H35    72     1.09551   109.98538  -162.45430
   63    61 S   HC   _H36    73     1.09525   111.51007    78.08118
   64    61 S   HC   _H37    74     1.09578   111.22423   -43.99373
   65    54 S   CT   _C18    80     1.53693   115.55294    -3.66394
   66    65 S   HC   _H20    81     1.09822   108.67442   173.08403
   67    65 S   HC   _H21    82     1.09306   112.25730   -70.53795
   68    45 S   CA   _C13    46     1.41473   122.67202   156.62432
   69    56 S   N    _N5_    49     1.41753   123.88898  -179.27909
   70    69 S   H    _H15    50     1.01847   113.69536  -178.99770
   71    65 S   CT   _C19    83     1.53746   108.61540    54.60460
   72    71 S   HC   _H4_    84     1.09695   102.97607    58.68741
   73    68 S   OH   _O34    47     1.37894   121.81987    -4.89633
   74    73 S   HO   _H17    48     0.97595   107.36576     6.88815
   75    69 S   C    _C7_    51     1.38649   128.09487     1.19518
   76    75 S   O    _O33    52     1.22795   127.63693    -0.77632
   77    71 S   CT   _C20    85     1.56216   112.75885   173.93434
   78    77 S   HC   _H5_    86     1.10235   106.68475   -43.49167
   79    75 S   CT1  _C6_    53     1.51804   111.67729   179.87180
   80    79 S   HC   _H13    54     1.09528   107.80446    92.67699
   81    79 S   HC   _H14    55     1.09473   112.49493   -28.47953
   82    77 S   CMA  _C21    87     1.55592   107.89001    75.54579
   83    82 S   OM   _O39    88     1.26580   111.08623  -127.19670
   84    77 S   NT   _N7_   100     1.50747   113.13769  -160.75648
   85    79 S   NP   _N4_    56     1.51767   111.69776  -149.43168
   86    85 S   H    _H9_    57     1.03015   106.64151   -46.14584
   87    82 S   CM   _C22    89     1.35768   117.24448    54.28023
   88    84 S   CT   _C27   101     1.47108   111.76842   179.36944
   89    88 S   HC   _H26   102     1.09667   110.63303  -177.93654
   90    88 S   HC   _H27   103     1.09433   111.72583    65.39529
   91    88 S   HC   _H28   104     1.09597   112.05679   -57.28119
   92    84 S   CT   _C28   105     1.46821   112.62584    57.60776
   93    92 S   HC   _H29   106     1.09684   110.85083   173.19150
   94    92 S   HC   _H30   107     1.09571   112.08995    52.48414
   95    92 S   HC   _H31   108     1.09307   111.76786   -70.41232
   96    85 S   CT   _C4_    58     1.50505   112.67995    70.90005
   97    96 S   HC   _H6_    59     1.09328   108.58322    62.93025
   98    96 S   HC   _H7_    60     1.09324   107.98916  -176.70669
   99    96 S   HC   _H8_    61     1.09249   108.58024   -57.84164
  100    85 S   CT   _C5_    62     1.50303   111.79514  -162.63563
  101   100 S   HC   _H10    63     1.09325   108.58270   -62.49174
  102   100 S   HC   _H11    64     1.09313   108.10401    58.09566
  103   100 S   HC   _H12    65     1.09318   108.12297   176.89770
  104    87 S   CO4  _C23    90     1.50106   116.42189    -9.23359
  105   104 S   O    _O35    91     1.23155   120.19865   145.51332
  106    87 S   C    _C26    95     1.50467   125.24100   173.92220
  107   106 S   O    _O38    96     1.22937   121.08714   160.47719
  108   106 S   N    _N6_    97     1.36936   116.39332   -21.28714
  109   108 S   H    _H24    98     1.01567   121.82841     3.00993
  110   108 S   H    _H25    99     1.01644   120.67683  -178.52091
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  19   2   1   1  19  19   6   1  11   4   8   2  13  15  18  11
   4   3  10   4   9   7   4   8   7   3   2   1   3   2   1   1
   9   4   3   5   8   3  11   5   1   1   8   4  15   6  12   5
   4  10   4   9   9   8   7   7   3   2   1   3   2   1   1   7
   3   2   1   3   2   1   1   4   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    41    54    71   104    38    43    39    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    41    42    45    48    54    55    65    71    72    77    87   104   105    38    43    44    39    40  
   35    36  
   36  
    0  
   41    42    45    46    68    48    49    50    54    55    65    66    67    71   104    38    43    39    40  
   43    44   106    84    39    40    41    54    65    66    67    71    72    77    78    82    87   104   105  
   40    41    43    54    71   104  
    0  
   42    45    46    47    56    68    73    48    54    55    65  
   45    46    68    54  
   44    65    71    72    77    87   104   105  
   71   104  
   46    47    51    56    68    73    74    69    53    48    49    50    54  
   47    51    52    56    68    73    53    57    61    48    49    50    54    55    65  
   51    52    56    68    69    53    57    58    59    60    61    62    63    64    48    49    50    54  
   49    50    54    55    65    66    67    71    51    53    68  
   50    54    55    65  
   54    55    65  
   52    56    68    73    69    70    75    53    57    61  
   56    68    69    53  
   57    58    59    60    61    62    63    64    56  
   55    65    66    67    71    72    77  
   65    66    67    71  
   68    73    74    69    70    75    76    79  
   58    59    60    61    62    63    64  
   59    60    61  
   60    61  
   61  
   62    63    64  
   63    64  
   64  
    0  
   66    67    71    72    77    78    82   104    84  
   67    71    72    77  
   71    72    77  
   73    74    69    70    75  
   70    75    76    79    80    81    85    73  
   75    76    79  
   72    77    78    82    83    87   104   105    84    88    92  
   77    78    82   104    84  
   74  
    0  
   76    79    80    81    85    86    96   100  
   79    80    81    85  
   78    82    83    87   104   106    84    88    89    90    91    92    93    94    95  
   82    83    87    84    88    92  
   80    81    85    86    96    97    98    99   100   101   102   103  
   81    85    86    96   100  
   85    86    96   100  
   83    87   104   105   106   107   108    84    88    92  
   87   104   106    84  
   88    89    90    91    92    93    94    95    87  
   86    96    97    98    99   100   101   102   103  
   96    97    98    99   100   101   102   103  
  104   105   106   107   108   109   110  
   89    90    91    92    93    94    95  
   90    91    92  
   91    92  
   92  
   93    94    95  
   94    95  
   95  
    0  
   97    98    99   100   101   102   103  
   98    99   100  
   99   100  
  100  
  101   102   103  
  102   103  
  103  
    0  
  105   106   107   108  
  106  
  107   108   109   110  
  108   109   110  
  109   110  
  110  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.432500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.210000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   54   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   69   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   70   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   71   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   74   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   75   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   77   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660   0.002500   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   82   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   83   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   84   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   85   3.2500   0.1700   0.047500   2.1950   1.9500   0.003973653   1.685851020
   86   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   87   3.5500   0.0760  -0.657900   2.0020   1.7750   0.023028004  -0.852763146
   88   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   92   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  100   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  104   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  105   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  106   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
  107   2.9600   0.2100  -0.500000   1.8100   1.6000   0.001000000  -1.480495490
  108   3.2500   0.1700  -0.760000   1.8100   1.6000   0.054801302  -1.445846770
  109   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
  110   0.5000   0.0300   0.380000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    38   268.000  1.529
   33    39   320.000  1.410
   37    41   465.000  1.376
   37    54   317.000  1.510
   41    42   745.000  1.250
   41    45   320.000  1.460
   45    46   469.000  1.400
   45    68   469.000  1.400
   46    47   469.000  1.400
   46    48   317.000  1.510
   47    51   469.000  1.400
   47    53   481.000  1.340
   51    52   367.000  1.080
   51    56   469.000  1.400
   56    68   469.000  1.400
   56    69   360.000  1.404
   68    73   450.000  1.364
   73    74   553.000  0.945
   69    70   434.000  1.010
   69    75   490.000  1.335
   75    76   570.000  1.229
   75    79   317.000  1.522
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    85   367.000  1.471
   85    86   434.000  1.010
   85    96   367.000  1.471
   85   100   367.000  1.471
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   340.000  1.090
   53    57   382.000  1.448
   53    61   382.000  1.448
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    54   268.000  1.529
   54    55   340.000  1.090
   54    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    71   268.000  1.529
   71    72   340.000  1.090
   71    77   268.000  1.529
   71    38   268.000  1.529
   77    78   340.000  1.090
   77    82   270.000  1.512
   77    84   382.000  1.448
   82    83   745.000  1.250
   82    87   465.000  1.376
   87   104   320.000  1.462
   87   106   410.000  1.444
  104   105   570.000  1.229
  104    38   317.000  1.522
   38    43   320.000  1.410
   43    44   553.000  0.945
  106   107   570.000  1.229
  106   108   490.000  1.335
  108   109   434.000  1.010
  108   110   434.000  1.010
   84    88   382.000  1.448
   84    92   382.000  1.448
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   340.000  1.090
   92    93   340.000  1.090
   92    94   340.000  1.090
   92    95   340.000  1.090
   39    40   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    38    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    41    70.00000  124.00000
   33    37    54    65.00000  117.92700
   33    38    71    58.35000  112.70000
   33    38   104    63.00000  111.10000
   33    38    43    50.00000  109.50000
   33    39    40    55.00000  108.50000
   37    41    42    65.00000  137.10300
   37    41    45    60.00000  123.20500
   37    54    48    70.00000  112.02700
   37    54    55    35.00000  109.50000
   37    54    65    70.00000  112.02700
   41    45    46    60.00000  120.93500
   41    45    68    60.00000  120.93500
   45    41    42    85.00000  114.86500
   45    46    47    63.00000  120.00000
   45    46    48    70.00000  120.00000
   45    68    56    63.00000  120.00000
   45    68    73    70.00000  120.00000
   46    47    51    63.00000  120.00000
   46    47    53    70.00000  120.10000
   46    48    49    35.00000  109.50000
   46    48    50    35.00000  109.50000
   46    48    54    70.00000  112.17500
   47    51    52    35.00000  120.00000
   47    51    56    63.00000  120.00000
   47    53    57    50.00000  120.00000
   47    53    61    50.00000  120.00000
   51    56    68    63.00000  120.00000
   51    56    69    70.00000  119.01900
   56    51    52    35.00000  120.00000
   56    68    73    70.00000  120.00000
   56    69    70    45.00000  118.23600
   56    69    75    65.00000  121.96500
   68    45    46    63.00000  120.00000
   68    73    74    35.00000  113.00000
   69    56    68    70.00000  119.01900
   69    75    76    80.00000  122.90000
   69    75    79    70.00000  116.60000
   75    69    70    35.00000  119.80000
   75    79    80    35.00000  109.50000
   75    79    81    35.00000  109.50000
   75    79    85    80.00000  111.20000
   79    75    76    80.00000  120.40000
   79    85    86    35.00000  109.50000
   79    85    96    75.00000  113.01200
   79    85   100    75.00000  113.01200
   81    79    80    33.00000  107.80000
   85    79    80    35.00000  109.50000
   85    79    81    35.00000  109.50000
   85    96    97    35.00000  109.50000
   85    96    98    35.00000  109.50000
   85    96    99    35.00000  109.50000
   85   100   101    35.00000  109.50000
   85   100   102    35.00000  109.50000
   85   100   103    35.00000  109.50000
   96    85    86    35.00000  109.50000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
  100    85    86    35.00000  109.50000
  100    85    96    75.00000  113.01200
  102   100   101    33.00000  107.80000
  103   100   101    33.00000  107.80000
  103   100   102    33.00000  107.80000
   53    47    51    70.00000  120.10000
   53    57    58    35.00000  109.50000
   53    57    59    35.00000  109.50000
   53    57    60    35.00000  109.50000
   53    61    62    35.00000  109.50000
   53    61    63    35.00000  109.50000
   53    61    64    35.00000  109.50000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   61    53    57    50.00000  115.00000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   48    46    47    70.00000  120.00000
   48    54    55    37.50000  110.70000
   48    54    65    58.35000  112.70000
   50    48    49    33.00000  107.80000
   54    37    41    70.00000  124.00000
   54    48    49    37.50000  110.70000
   54    48    50    37.50000  110.70000
   54    65    66    37.50000  110.70000
   54    65    67    37.50000  110.70000
   54    65    71    58.35000  112.70000
   65    54    55    37.50000  110.70000
   65    71    72    37.50000  110.70000
   65    71    77    58.35000  112.70000
   65    71    38    58.35000  112.70000
   67    65    66    33.00000  107.80000
   71    65    66    37.50000  110.70000
   71    65    67    37.50000  110.70000
   71    77    78    37.50000  110.70000
   71    77    82    70.00000  112.02700
   71    77    84    56.20000  109.47000
   71    38   104    63.00000  111.10000
   71    38    43    50.00000  109.50000
   77    71    72    37.50000  110.70000
   77    82    83    85.00000  112.85300
   77    82    87    65.00000  122.18000
   77    84    88    51.80000  107.20000
   77    84    92    51.80000  107.20000
   82    77    78    45.00000  110.52000
   82    87   104    60.00000  125.92000
   82    87   106    60.00000  120.04000
   87    82    83    65.00000  137.10300
   87   104   105    80.00000  123.72100
   87   104    38    65.00000  118.62400
   87   106   107    80.00000  125.30000
   87   106   108    80.00000  111.56200
  104    38    43    90.00000  109.61100
   38    33    37    70.00000  112.02700
   38    71    72    37.50000  110.70000
   38    71    77    58.35000  112.70000
   38   104   105    80.00000  120.40000
   38    43    44    55.00000  108.50000
  106    87   104    55.00000  123.68000
  106   108   109    35.00000  119.80000
  106   108   110    35.00000  119.80000
  108   106   107    80.00000  122.90000
  110   108   109    35.00000  120.00000
   84    77    78    35.00000  109.50000
   84    77    82    75.00000  110.70900
   84    88    89    35.00000  109.50000
   84    88    90    35.00000  109.50000
   84    88    91    35.00000  109.50000
   84    92    93    35.00000  109.50000
   84    92    94    35.00000  109.50000
   84    92    95    35.00000  109.50000
   90    88    89    33.00000  107.80000
   91    88    89    33.00000  107.80000
   91    88    90    33.00000  107.80000
   92    84    88    51.80000  107.20000
   94    92    93    33.00000  107.80000
   95    92    93    33.00000  107.80000
   95    92    94    33.00000  107.80000
   39    33    37    90.00000  110.39200
   39    33    38    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
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   84    77    82    83   0.15600 -1.0 2.0
   84    77    82    83  -0.50800  1.0 3.0
   84    77    82    87   0.90200  1.0 1.0
   84    77    82    87   0.57900 -1.0 2.0
   84    77    82    87  -0.62100  1.0 3.0
   88    84    92    93   0.28000  1.0 3.0
   88    84    92    94   0.28000  1.0 3.0
   88    84    92    95   0.28000  1.0 3.0
   92    84    88    89   0.28000  1.0 3.0
   92    84    88    90   0.28000  1.0 3.0
   92    84    88    91   0.28000  1.0 3.0
   39    33    37    41   0.67800  1.0 1.0
   39    33    37    41   0.47050 -1.0 2.0
   39    33    37    41  -0.62500  1.0 3.0
   39    33    37    54   0.18000  1.0 1.0
   39    33    37    54   0.16450 -1.0 2.0
   39    33    37    54   0.04450  1.0 3.0
   39    33    38    71   0.86500  1.0 1.0
   39    33    38    71  -0.17500 -1.0 2.0
   39    33    38    71   0.20800  1.0 3.0
   39    33    38   104  -0.09450  1.0 1.0
   39    33    38   104  -1.12950 -1.0 2.0
   39    33    38   104   0.54000  1.0 3.0
   39    33    38    43   3.75450  1.0 1.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    54    37    41   1.10000 -1.0 2.0
   45    42    41    37   1.10000 -1.0 2.0
   46    68    45    41   4.00000 -1.0 2.0
   47    48    46    45   4.00000 -1.0 2.0
   51    53    47    46   4.00000 -1.0 2.0
   56    52    51    47   1.10000 -1.0 2.0
   68    69    56    51   4.00000 -1.0 2.0
   56    73    68    45   4.00000 -1.0 2.0
   70    75    69    56   1.00000 -1.0 2.0
   69    79    75    76  10.50000 -1.0 2.0
   61    47    53    57   1.00000 -1.0 2.0
   77    83    82    87   1.10000 -1.0 2.0
  104   106    87    82   1.10000 -1.0 2.0
   87    38   104   105  10.50000 -1.0 2.0
   87   108   106   107  10.50000 -1.0 2.0
  110   106   108   109   1.00000 -1.0 2.0
END
